CID 45073799

4-(furan-3-yl)piperidine hydrochloride

Structural Information

Molecular Formula
C9H13NO
SMILES
C1CNCCC1C2=COC=C2
InChI
InChI=1S/C9H13NO/c1-4-10-5-2-8(1)9-3-6-11-7-9/h3,6-8,10H,1-2,4-5H2
InChIKey
SZWFKWLVQFPBGD-UHFFFAOYSA-N
Compound name
4-(furan-3-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

151.09972 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.10700 131.5
[M+Na]+ 174.08894 136.7
[M-H]- 150.09244 135.3
[M+NH4]+ 169.13354 150.5
[M+K]+ 190.06288 135.4
[M+H-H2O]+ 134.09698 124.8
[M+HCOO]- 196.09792 150.5
[M+CH3COO]- 210.11357 144.0
[M+Na-2H]- 172.07439 137.0
[M]+ 151.09917 125.9
[M]- 151.10027 125.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe